3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(5-pentan-3-yl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[5-(1-ethylpropyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C18H23N3O3S MolecularWeight: 361.45852

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=NN=C(S1)NC(=O)CCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CCC(CC)C1=NN=C(S1)NC(=O)CCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C18H23N3O3S/c1-3-13(4-2)17-20-21-18(25-17)19-16(22)8-6-12-5-7-14-15(11-12)24-10-9-23-14/h5,7,11,13H,3-4,6,8-10H2,1-2H3,(H,19,21,22)